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CHEBI:175090 - Oleacein

ChEBI IDCHEBI:175090
ChEBI NameOleacein
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SubmitterMetaboLights
DownloadsMolfile
FormulaC17H20O6
Net Charge0
Average Mass320.341
Monoisotopic Mass320.12599
SMILESC/C=C(\C=O)C(CC=O)CC(=O)OCCc1ccc(O)c(O)c1
InChIInChI=1S/C17H20O6/c1-2-13(11-19)14(5-7-18)10-17(22)23-8-6-12-3-4-15(20)16(21)9-12/h2-4,7,9,11,14,20-21H,5-6,8,10H2,1H3/b13-2+
InChIKeyXLPXUPOZUYGVPD-XNJYKOPJSA-N
ChEBI Ontology
Outgoing Relation(s)
Oleacein (CHEBI:175090) is a alcohol (CHEBI:30879)
Oleacein (CHEBI:175090) is a phenols (CHEBI:33853)
IUPAC Name 
2-(3,4-dihydroxyphenyl)ethyl (Z)-4-ormyl-3-(2-oxoethyl)hex-4-enoate
Manual XrefsDatabases
HMDB0037321HMDB
18953409ChemSpider